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Bis(2-ethylhexyl) benzo[b]thiophene-5,6-dicarboxylate

View entire compound with spectra: 1 MS (GC)

Bis(2-ethylhexyl) benzo[b]thiophene-5,6-dicarboxylate
SpectraBase Compound ID JYrxz8KpjE
InChI InChI=1S/C26H38O4S/c1-5-9-11-19(7-3)17-29-25(27)22-15-21-13-14-31-24(21)16-23(22)26(28)30-18-20(8-4)12-10-6-2/h13-16,19-20H,5-12,17-18H2,1-4H3
InChIKey YRSFBEXKTZCSRC-UHFFFAOYSA-N
Mol Weight 446.6 g/mol
Molecular Formula C26H38O4S
Exact Mass 446.249081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XIa2FUuvfT
Name Bis(2-ethylhexyl) benzo[b]thiophene-5,6-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38O4S
InChI InChI=1S/C26H38O4S/c1-5-9-11-19(7-3)17-29-25(27)22-15-21-13-14-31-24(21)16-23(22)26(28)30-18-20(8-4)12-10-6-2/h13-16,19-20H,5-12,17-18H2,1-4H3
InChIKey YRSFBEXKTZCSRC-UHFFFAOYSA-N
Molecular Weight 446.646 g/mol
SMILES c1(c(cc2c(c1)ccs2)C(OCC(CC)CCCC)=O)C(OCC(CC)CCCC)=O
SPLASH splash10-0ab9-0090000000-d6d5b50fe8f09121b75c
Source of Spectrum F-69-167-4g
Wiley ID 1737317